(5R)-1-[(2S)-butan-2-yl]-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-6-oxidanylidene-2-sulfanylidene-5H-pyrimidin-4-olate

Systemtic Name: (5R)-1-[(2S)-butan-2-yl]-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-6-oxidanylidene-2-sulfanylidene-5H-pyrimidin-4-olate Openeye Name: (5R)-1-[(1S)-1-methylpropyl]-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-6-oxo-2-thioxo-5H-pyrimidin-4-olate CAS Name: (5R)-1-[(2S)-butan-2-yl]-5-[2-(4-morpholin-4-iumyl)ethyliminomethyl]-6-oxo-2-sulfanylidene-5H-pyrimidin-4-olate IUPAC Name: (5R)-1-[(2S)-butan-2-yl]-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-6-oxo-2-sulfanylidene-5H-pyrimidin-4-olate Traditional Name: (5R)-6-keto-1-[(1S)-1-methylpropyl]-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-2-thioxo-5H-pyrimidin-4-olate Formula: C15H24N4O3S MolecularWeight: 340.44106

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(C(=NC1=S)[O-])C=NCC[NH+]2CCOCC2

Isomeric SMILES

CC[C@H](C)N1C(=O)[C@@H](C(=NC1=S)[O-])C=NCC[NH+]2CCOCC2

InChI

InChI=1S/C15H24N4O3S/c1-3-11(2)19-14(21)12(13(20)17-15(19)23)10-16-4-5-18-6-8-22-9-7-18/h10-12H,3-9H2,1-2H3,(H,17,20,23)/t11-,12+/m0/s1